Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ob2_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 5.A N MET 1.A O no hydrogen 3.219 N/A CYS 5.A SG MET 1.A O no hydrogen 3.919 N/A TRP 6.A N VAL 2.A O no hydrogen 3.200 N/A LYS 7.A N GLU 3.A O no hydrogen 3.317 N/A LEU 8.A N LYS 4.A O no hydrogen 3.142 N/A MET 9.A N CYS 5.A O no hydrogen 2.733 N/A ASP 10.A N TRP 6.A O no hydrogen 2.734 N/A LYS 11.A N LYS 7.A O no hydrogen 3.154 N/A VAL 12.A N LEU 8.A O no hydrogen 3.144 N/A VAL 13.A N MET 9.A O no hydrogen 3.007 N/A ARG 14.A N ASP 10.A O no hydrogen 2.995 N/A LEU 15.A N LYS 11.A O no hydrogen 2.697 N/A CYS 16.A N VAL 12.A O no hydrogen 2.657 N/A CYS 16.A SG VAL 12.A O no hydrogen 3.437 N/A GLN 17.A N ARG 14.A O no hydrogen 3.140 N/A ASN 18.A N LEU 15.A O no hydrogen 3.506 N/A LYS 20.A N ASN 18.A OD1 no hydrogen 2.999 N/A LEU 21.A N ASN 18.A O no hydrogen 3.087 N/A ALA 22.A N PRO 19.A O no hydrogen 3.054 N/A SER 26.A OG ASP 221.A OD1 no hydrogen 3.359 N/A SER 26.A OG ASP 221.A OD2 no hydrogen 2.558 N/A ASP 32.A N TYR 29.A O no hydrogen 2.830 N/A LEU 33.A N TYR 29.A O no hydrogen 3.007 N/A LEU 34.A N ILE 30.A O no hydrogen 3.192 N/A ASP 36.A N ASP 32.A O no hydrogen 2.924 N/A THR 37.A N LEU 33.A O no hydrogen 2.862 N/A THR 37.A OG1 LEU 33.A O no hydrogen 2.597 N/A TYR 38.A N LEU 34.A O no hydrogen 2.818 N/A GLN 39.A N PRO 35.A O no hydrogen 2.769 N/A HIS 40.A N ASP 36.A O no hydrogen 2.994 N/A LEU 41.A N THR 37.A O no hydrogen 2.760 N/A ARG 42.A N TYR 38.A O no hydrogen 2.693 N/A ARG 42.A NH1 GLN 39.A OE1 no hydrogen 2.799 N/A THR 43.A N GLN 39.A O no hydrogen 2.961 N/A THR 43.A OG1 GLN 39.A O no hydrogen 3.261 N/A ILE 44.A N HIS 40.A O no hydrogen 3.076 N/A LEU 45.A N LEU 41.A O no hydrogen 3.116 N/A SER 46.A N ARG 42.A O no hydrogen 3.020 N/A SER 46.A OG THR 43.A O no hydrogen 2.649 N/A ARG 47.A N THR 43.A O no hydrogen 3.097 N/A ARG 47.A NH1 SER 117.A O no hydrogen 2.776 N/A TYR 48.A N LEU 45.A O no hydrogen 3.242 N/A LYS 51.A NZ ARG 47.A O no hydrogen 3.442 N/A MET 52.A N GLY 50.A O no hydrogen 2.642 N/A LEU 55.A N LYS 51.A O no hydrogen 3.438 N/A GLY 56.A N MET 52.A O no hydrogen 2.897 N/A GLU 57.A N THR 54.A O no hydrogen 3.098 N/A ASN 58.A N LEU 55.A O no hydrogen 3.181 N/A TYR 60.A OH GLU 110.A OE1 no hydrogen 2.664 N/A PHE 61.A N ASN 58.A OD1 no hydrogen 2.754 N/A ARG 62.A N ASN 58.A O no hydrogen 3.069 N/A ARG 62.A NH1 GLU 57.A O no hydrogen 2.852 N/A VAL 63.A N GLU 59.A O no hydrogen 3.042 N/A PHE 64.A N TYR 60.A O no hydrogen 2.788 N/A MET 65.A N PHE 61.A O no hydrogen 2.961 N/A GLU 66.A N ARG 62.A O no hydrogen 3.034 N/A ASN 67.A N VAL 63.A O no hydrogen 2.932 N/A ASN 67.A ND2 THR 177.A O no hydrogen 2.894 N/A LEU 68.A N PHE 64.A O no hydrogen 2.823 N/A MET 69.A N MET 65.A O no hydrogen 2.853 N/A LYS 70.A N GLU 66.A O no hydrogen 2.879 N/A LYS 71.A N ASN 67.A O no hydrogen 2.690 N/A LYS 71.A NZ ASN 67.A OD1 no hydrogen 2.731 N/A LYS 71.A NZ CYS 178.A O no hydrogen 2.761 N/A THR 72.A N LEU 68.A O no hydrogen 3.066 N/A THR 72.A OG1 LEU 68.A O no hydrogen 3.241 N/A THR 72.A OG1 MET 69.A O no hydrogen 2.944 N/A LYS 73.A N MET 69.A O no hydrogen 3.022 N/A GLN 74.A N LYS 70.A O no hydrogen 2.909 N/A THR 75.A N LYS 71.A O no hydrogen 2.900 N/A THR 75.A OG1 LYS 71.A O no hydrogen 3.007 N/A ILE 76.A N THR 72.A O no hydrogen 2.934 N/A SER 77.A N LYS 73.A O no hydrogen 2.788 N/A SER 77.A OG GLU 81.A OE2 no hydrogen 3.244 N/A LEU 78.A N GLN 74.A O no hydrogen 2.818 N/A PHE 79.A N THR 75.A O no hydrogen 3.120 N/A LYS 80.A N ILE 76.A O no hydrogen 3.067 N/A GLU 81.A N SER 77.A O no hydrogen 3.043 N/A GLY 82.A N LEU 78.A O no hydrogen 2.947 N/A LYS 83.A N PHE 79.A O no hydrogen 3.060 N/A ARG 85.A N GLY 82.A O no hydrogen 2.959 N/A MET 86.A N LYS 83.A O no hydrogen 3.375 N/A TYR 87.A N GLU 84.A O no hydrogen 3.218 N/A SER 91.A N GLU 88.A O no hydrogen 2.955 N/A SER 91.A OG ARG 85.A O no hydrogen 2.637 N/A SER 91.A OG GLU 88.A O no hydrogen 3.193 N/A GLN 92.A NE2 ASN 96.A OD1 no hydrogen 3.311 N/A ARG 94.A N SER 91.A OG no hydrogen 3.062 N/A ARG 94.A NE MET 86.A O no hydrogen 3.139 N/A ARG 95.A N SER 91.A O no hydrogen 3.034 N/A ARG 95.A NH1 PHE 217.A O no hydrogen 3.060 N/A ARG 95.A NH1 GLU 222.A OE1 no hydrogen 2.818 N/A ARG 95.A NH2 PHE 217.A O no hydrogen 2.891 N/A ASN 96.A N GLN 92.A O no hydrogen 2.876 N/A LEU 97.A N PRO 93.A O no hydrogen 3.191 N/A THR 98.A N ARG 94.A O no hydrogen 3.112 N/A THR 98.A OG1 ARG 94.A O no hydrogen 3.350 N/A LYS 99.A N ARG 95.A O no hydrogen 2.992 N/A LEU 100.A N ASN 96.A O no hydrogen 2.925 N/A SER 101.A N LEU 97.A O no hydrogen 2.907 N/A SER 101.A OG LEU 97.A O no hydrogen 2.692 N/A LEU 102.A N THR 98.A O no hydrogen 3.017 N/A ILE 103.A N LYS 99.A O no hydrogen 2.889 N/A PHE 104.A N LEU 100.A O no hydrogen 2.704 N/A SER 105.A N SER 101.A O no hydrogen 2.957 N/A HIS 106.A N LEU 102.A O no hydrogen 2.865 N/A MET 107.A N ILE 103.A O no hydrogen 2.881 N/A LEU 108.A N PHE 104.A O no hydrogen 3.032 N/A ALA 109.A N SER 105.A O no hydrogen 3.097 N/A GLU 110.A N HIS 106.A O no hydrogen 2.910 N/A LEU 111.A N MET 107.A O no hydrogen 2.968 N/A LYS 112.A N LEU 108.A O no hydrogen 2.862 N/A GLY 113.A N ALA 109.A O no hydrogen 2.835 N/A ILE 114.A N GLU 110.A O no hydrogen 2.868 N/A PHE 115.A N LEU 111.A O no hydrogen 2.707 N/A GLY 118.A N PHE 115.A O no hydrogen 2.953 N/A PHE 120.A N TYR 48.A OH no hydrogen 2.822 N/A GLN 121.A N ILE 114.A O no hydrogen 2.759 N/A THR 124.A N GLN 121.A O no hydrogen 3.021 N/A THR 124.A OG1 GLN 121.A O no hydrogen 3.260 N/A PHE 125.A N GLY 122.A O no hydrogen 3.443 N/A THR 128.A N ASP 188.A OD1 no hydrogen 2.700 N/A THR 128.A OG1 ASP 188.A OD1 no hydrogen 3.277 N/A THR 128.A OG1 ASP 188.A OD2 no hydrogen 3.291 N/A ALA 133.A N LYS 129.A O no hydrogen 2.893 N/A GLU 134.A N ALA 130.A O no hydrogen 3.133 N/A PHE 135.A N ASP 131.A O no hydrogen 3.279 N/A TRP 136.A N ALA 132.A O no hydrogen 3.080 N/A TRP 136.A NE1 LYS 143.A O no hydrogen 3.036 N/A ARG 137.A N ALA 133.A O no hydrogen 2.901 N/A ARG 137.A NH1 PHE 125.A O no hydrogen 2.858 N/A ARG 137.A NH2 GLY 141.A O no hydrogen 2.367 N/A LYS 138.A N GLU 134.A O no hydrogen 2.975 N/A ALA 139.A N PHE 135.A O no hydrogen 2.972 N/A PHE 140.A N TRP 136.A O no hydrogen 2.695 N/A GLY 141.A N ARG 137.A O no hydrogen 2.848 N/A LYS 143.A N PHE 140.A O no hydrogen 3.119 N/A VAL 146.A N ILE 182.A O no hydrogen 3.019 N/A TRP 148.A N ASP 180.A O no hydrogen 2.913 N/A PHE 151.A N PRO 147.A O no hydrogen 2.960 N/A ARG 152.A N TRP 148.A O no hydrogen 2.609 N/A GLN 153.A N LYS 149.A O no hydrogen 2.925 N/A ALA 154.A N SER 150.A O no hydrogen 3.145 N/A LEU 155.A N PHE 151.A O no hydrogen 2.859 N/A HIS 156.A N ARG 152.A O no hydrogen 2.820 N/A GLU 157.A N GLN 153.A O no hydrogen 3.224 N/A GLU 157.A N ALA 154.A O no hydrogen 3.244 N/A VAL 158.A N LEU 155.A O no hydrogen 2.799 N/A HIS 159.A N LEU 155.A O no hydrogen 2.664 N/A ILE 161.A N HIS 156.A ND1 no hydrogen 2.993 N/A SER 162.A N GLU 166.A OE2 no hydrogen 3.282 N/A GLU 166.A N SER 163.A OG no hydrogen 3.048 N/A ALA 167.A N SER 163.A O no hydrogen 2.981 N/A MET 168.A N GLY 164.A O no hydrogen 2.923 N/A ALA 169.A N LEU 165.A O no hydrogen 2.881 N/A LEU 170.A N GLU 166.A O no hydrogen 2.813 N/A LYS 171.A N ALA 167.A O no hydrogen 2.827 N/A LYS 171.A NZ ASP 180.A OD1 no hydrogen 2.403 N/A SER 172.A N MET 168.A O no hydrogen 3.018 N/A SER 172.A OG ALA 169.A O no hydrogen 3.263 N/A THR 173.A N ALA 169.A O no hydrogen 3.109 N/A THR 173.A OG1 ALA 169.A O no hydrogen 2.958 N/A ILE 174.A N LEU 170.A O no hydrogen 2.885 N/A ASP 175.A N LYS 171.A O no hydrogen 2.917 N/A LEU 176.A N ILE 174.A O no hydrogen 2.920 N/A THR 177.A N GLU 186.A OE2 no hydrogen 2.825 N/A THR 177.A OG1 GLU 186.A OE2 no hydrogen 2.650 N/A CYS 178.A N ASP 175.A O no hydrogen 2.958 N/A CYS 178.A SG ASP 175.A O no hydrogen 3.527 N/A CYS 178.A SG LEU 176.A O no hydrogen 3.999 N/A ASN 179.A N ASP 175.A OD1 no hydrogen 3.115 N/A ASP 180.A N ASP 175.A OD2 no hydrogen 2.825 N/A TYR 181.A N ASN 179.A OD1 no hydrogen 2.942 N/A ILE 182.A N VAL 146.A O no hydrogen 2.875 N/A SER 183.A N GLU 186.A OE1 no hydrogen 2.864 N/A SER 183.A OG GLU 110.A OE2 no hydrogen 2.449 N/A SER 183.A OG GLU 186.A OE1 no hydrogen 3.482 N/A VAL 184.A N THR 144.A O no hydrogen 2.826 N/A GLU 186.A N SER 183.A OG no hydrogen 2.933 N/A PHE 187.A N SER 183.A O no hydrogen 2.780 N/A ASP 188.A N VAL 184.A O no hydrogen 2.809 N/A ILE 189.A N PHE 185.A O no hydrogen 3.015 N/A PHE 190.A N GLU 186.A O no hydrogen 3.027 N/A THR 191.A N PHE 187.A O no hydrogen 3.042 N/A THR 191.A OG1 PHE 187.A O no hydrogen 2.866 N/A THR 191.A OG1 ASP 188.A O no hydrogen 3.204 N/A ARG 192.A N ASP 188.A O no hydrogen 2.834 N/A ARG 192.A NH1 LEU 246.A O no hydrogen 3.250 N/A LEU 193.A N ILE 189.A O no hydrogen 2.839 N/A PHE 194.A N PHE 190.A O no hydrogen 2.887 N/A SER 199.A N PRO 196.A O no hydrogen 3.232 N/A SER 199.A OG ASN 203.A OD1 no hydrogen 2.755 N/A LEU 200.A N TRP 197.A O no hydrogen 2.993 N/A ASN 203.A N SER 199.A O no hydrogen 2.926 N/A ASN 203.A ND2 PHE 194.A O no hydrogen 2.826 N/A ASN 203.A ND2 PRO 196.A O no hydrogen 2.963 N/A TRP 204.A N LEU 200.A O no hydrogen 3.040 N/A TRP 204.A NE1 THR 173.A OG1 no hydrogen 3.064 N/A ASN 205.A N LEU 201.A O no hydrogen 2.847 N/A SER 206.A N ARG 202.A O no hydrogen 2.968 N/A SER 206.A OG ARG 202.A O no hydrogen 3.254 N/A LEU 207.A N ASN 203.A O no hydrogen 2.909 N/A ALA 208.A N TRP 204.A O no hydrogen 2.910 N/A VAL 209.A N TRP 204.A O no hydrogen 3.198 N/A THR 210.A N ASN 205.A O no hydrogen 2.891 N/A THR 210.A OG1 ASN 205.A O no hydrogen 3.013 N/A GLY 213.A N HIS 211.A ND1 no hydrogen 2.931 N/A TYR 214.A N HIS 211.A O no hydrogen 3.330 N/A MET 215.A N PHE 239.A O no hydrogen 2.803 N/A THR 219.A N GLU 222.A OE2 no hydrogen 2.978 N/A THR 219.A OG1 GLU 222.A OE2 no hydrogen 3.480 N/A GLU 222.A N THR 219.A OG1 no hydrogen 3.058 N/A VAL 223.A N THR 219.A O no hydrogen 2.929 N/A LYS 224.A N TYR 220.A O no hydrogen 3.022 N/A ALA 225.A N ASP 221.A O no hydrogen 2.924 N/A ARG 226.A N GLU 222.A O no hydrogen 2.888 N/A ARG 226.A NE ASP 287.A OD1 no hydrogen 2.766 N/A ARG 226.A NH2 ASP 287.A OD2 no hydrogen 2.929 N/A LEU 227.A N VAL 223.A O no hydrogen 3.047 N/A GLN 228.A N LYS 224.A O no hydrogen 3.326 N/A GLN 228.A N ALA 225.A O no hydrogen 3.345 N/A GLN 228.A NE2 LYS 224.A O no hydrogen 3.521 N/A LYS 229.A NZ ARG 226.A O no hydrogen 2.993 N/A PHE 230.A N LEU 227.A O no hydrogen 2.822 N/A ILE 231.A N GLN 228.A O no hydrogen 2.915 N/A LYS 233.A N PHE 230.A O no hydrogen 2.694 N/A LYS 233.A NZ GLY 288.A O no hydrogen 2.995 N/A LYS 233.A NZ ASN 290.A OD1 no hydrogen 2.908 N/A GLY 235.A N VAL 254.A O no hydrogen 3.011 N/A SER 236.A N LYS 233.A O no hydrogen 3.065 N/A SER 236.A OG LYS 233.A O no hydrogen 2.834 N/A TYR 237.A N PHE 285.A O no hydrogen 2.955 N/A TYR 237.A OH ASN 292.A OD1 no hydrogen 2.551 N/A ILE 238.A N GLY 252.A O no hydrogen 2.971 N/A PHE 239.A N GLY 213.A O no hydrogen 2.970 N/A ARG 240.A N ALA 250.A O no hydrogen 3.076 N/A ARG 240.A NH1 LEU 241.A O no hydrogen 3.029 N/A SER 242.A N GLN 248.A O no hydrogen 3.011 N/A CYS 243.A SG SER 105.A OG no hydrogen 3.705 N/A ARG 245.A N SER 242.A OG no hydrogen 2.949 N/A GLN 248.A N ARG 245.A O no hydrogen 2.995 N/A TRP 249.A NE1 LEU 193.A O no hydrogen 2.928 N/A ALA 250.A N ARG 240.A O no hydrogen 2.972 N/A ILE 251.A N THR 263.A O no hydrogen 2.887 N/A GLY 252.A N ILE 238.A O no hydrogen 2.798 N/A TYR 253.A N LEU 261.A O no hydrogen 2.885 N/A VAL 254.A N SER 236.A O no hydrogen 3.011 N/A THR 255.A N ASN 259.A O no hydrogen 2.850 N/A THR 255.A OG1 ASP 257.A OD2 no hydrogen 2.870 N/A THR 255.A OG1 ASN 259.A O no hydrogen 3.433 N/A GLY 258.A N THR 255.A O no hydrogen 3.187 N/A ASN 259.A N THR 255.A OG1 no hydrogen 3.084 N/A ASN 259.A ND2 ASP 257.A OD1 no hydrogen 2.803 N/A LEU 261.A N TYR 253.A O no hydrogen 2.998 N/A THR 263.A N ILE 251.A O no hydrogen 2.874 N/A LYS 268.A NZ ASP 276.A OD2 no hydrogen 2.766 N/A GLN 272.A NE2 ASP 276.A OD1 no hydrogen 3.057 N/A ALA 273.A N PRO 269.A O no hydrogen 3.163 N/A LEU 274.A N LEU 270.A O no hydrogen 2.977 N/A ILE 275.A N PHE 271.A O no hydrogen 2.947 N/A ASP 276.A N GLN 272.A O no hydrogen 2.850 N/A GLY 277.A N ALA 273.A O no hydrogen 2.843 N/A PHE 278.A N LEU 274.A O no hydrogen 2.780 N/A ARG 279.A N ILE 275.A O no hydrogen 2.887 N/A ARG 279.A NH2 ASP 276.A OD1 no hydrogen 3.402 N/A ARG 279.A NH2 GLU 280.A OE2 no hydrogen 3.011 N/A GLU 280.A N ASP 276.A O no hydrogen 2.842 N/A GLY 281.A N PHE 278.A O no hydrogen 2.872 N/A PHE 282.A N GLY 277.A O no hydrogen 2.905 N/A TYR 283.A N GLY 277.A O no hydrogen 2.997 N/A LEU 284.A N GLY 235.A O no hydrogen 2.828 N/A PHE 285.A N GLY 235.A O no hydrogen 2.927 N/A ASP 287.A N TYR 237.A O no hydrogen 2.783 N/A GLY 288.A N PHE 285.A O no hydrogen 2.796 N/A ARG 289.A N PRO 286.A O no hydrogen 2.943 N/A